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Title: Materials Data on BaLiP by Materials Project

Abstract

LiBaP crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Li1+ is bonded in a trigonal planar geometry to three equivalent P3- atoms. All Li–P bond lengths are 2.56 Å. Ba2+ is bonded to six equivalent P3- atoms to form a mixture of distorted corner, edge, and face-sharing BaP6 pentagonal pyramids. All Ba–P bond lengths are 3.42 Å. P3- is bonded in a distorted trigonal planar geometry to three equivalent Li1+ and six equivalent Ba2+ atoms.

Publication Date:
Other Number(s):
mp-10615
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; BaLiP; Ba-Li-P
OSTI Identifier:
1187228
DOI:
10.17188/1187228

Citation Formats

The Materials Project. Materials Data on BaLiP by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187228.
The Materials Project. Materials Data on BaLiP by Materials Project. United States. doi:10.17188/1187228.
The Materials Project. 2020. "Materials Data on BaLiP by Materials Project". United States. doi:10.17188/1187228. https://www.osti.gov/servlets/purl/1187228. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1187228,
title = {Materials Data on BaLiP by Materials Project},
author = {The Materials Project},
abstractNote = {LiBaP crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Li1+ is bonded in a trigonal planar geometry to three equivalent P3- atoms. All Li–P bond lengths are 2.56 Å. Ba2+ is bonded to six equivalent P3- atoms to form a mixture of distorted corner, edge, and face-sharing BaP6 pentagonal pyramids. All Ba–P bond lengths are 3.42 Å. P3- is bonded in a distorted trigonal planar geometry to three equivalent Li1+ and six equivalent Ba2+ atoms.},
doi = {10.17188/1187228},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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